@MOLECULE (5s,10r)-7,9-dibromo-n-(2-{2,6-dibromo-4-[3-(methylamino)propoxy]phenyl}ethyl)-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide 59 61 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 4.1478 -0.2686 0.4388 C.3 1 UNL1 0.0735 2 C 5.0420 0.6706 1.2958 C.3 1 UNL1 0.1242 3 C -6.2361 1.5407 -0.6321 C.ar 1 UNL1 -0.2581 4 C -6.1738 -0.7783 0.1166 C.ar 1 UNL1 -0.3092 5 C -1.9027 0.7626 0.4483 C.3 1 UNL1 -0.0537 6 C -2.6342 0.3012 -0.8324 C.3 1 UNL1 -0.3005 7 C -8.9751 -0.5644 0.4758 C.3 1 UNL1 -0.0437 8 C -10.4007 -0.0187 0.5185 C.3 1 UNL1 -0.3089 9 C -11.3848 -1.1556 0.8382 C.3 1 UNL1 -0.1104 10 C 8.4662 0.5454 -1.7004 C.3 1 UNL1 -0.1936 11 C -13.7690 -1.6577 1.0300 C.3 1 UNL1 -0.2757 12 H 5.6815 -0.5556 2.7240 H 1 UNL1 0.3242 13 H -0.1245 1.5402 -0.4267 H 1 UNL1 0.3250 14 H -12.8677 0.1510 1.4668 H 1 UNL1 0.2510 15 C -4.1087 0.3297 -0.5994 C.ar 1 UNL1 -0.0819 16 C -4.8714 1.4817 -0.8408 C.ar 1 UNL1 0.0302 17 C -4.8022 -0.7789 -0.1120 C.ar 1 UNL1 0.0371 18 C -6.8869 0.3908 -0.1500 C.ar 1 UNL1 0.2700 19 O -0.0217 -1.0505 1.4069 O.2 1 UNL1 -0.5016 20 C 2.8727 -0.6926 1.1946 C.3 1 UNL1 -0.2950 21 O 5.0620 0.2010 2.6209 O.3 1 UNL1 -0.5140 22 C 0.3720 -0.1408 0.7053 C.2 1 UNL1 0.5823 23 O 8.2726 -0.1073 -0.4438 O.2 1 UNL1 -0.3108 24 O -8.2156 0.5636 0.0169 O.3 1 UNL1 -0.3173 25 C 6.4309 0.7777 0.7560 C.2 1 UNL1 -0.1828 26 C 6.9607 -0.1475 -0.0631 C.2 1 UNL1 0.1896 27 C 1.8144 0.0017 0.3727 C.2 1 UNL1 -0.0484 28 C 6.1801 -1.3099 -0.4686 C.2 1 UNL1 -0.0663 29 O 3.6605 0.5768 -0.6690 O.2 1 UNL1 -0.0964 30 C 4.8669 -1.3955 -0.2249 C.2 1 UNL1 -0.1725 31 N -0.4593 0.8371 0.2165 N.am 1 UNL1 -0.5696 32 N -12.7598 -0.6063 0.7937 N.3 1 UNL1 -0.5198 33 BR 7.4357 2.2518 1.3401 Br 1 UNL1 0.0131 34 BR 7.1048 -2.7215 -1.3100 Br 1 UNL1 0.0060 35 BR -4.0525 3.0785 -1.4735 Br 1 UNL1 -0.0414 36 BR -3.8966 -2.3988 0.2991 Br 1 UNL1 -0.0271 37 N 2.3122 0.6766 -0.6191 N.2 1 UNL1 -0.1336 38 H 4.5344 1.6678 1.3946 H 1 UNL1 0.1863 39 H 2.7155 -1.7866 1.2376 H 1 UNL1 0.1883 40 H 2.8641 -0.3585 2.2553 H 1 UNL1 0.2055 41 H 4.2501 -2.2447 -0.5228 H 1 UNL1 0.1870 42 H -2.2648 1.7654 0.7697 H 1 UNL1 0.1479 43 H -2.1173 0.0579 1.2892 H 1 UNL1 0.1771 44 H -2.3376 0.9270 -1.6987 H 1 UNL1 0.1647 45 H -2.2748 -0.7086 -1.1252 H 1 UNL1 0.1740 46 H 8.1670 1.5963 -1.6433 H 1 UNL1 0.1384 47 H 9.5526 0.4574 -1.8355 H 1 UNL1 0.1572 48 H 7.9334 0.0287 -2.5034 H 1 UNL1 0.1364 49 H -6.8263 2.4380 -0.8246 H 1 UNL1 0.1949 50 H -6.6777 -1.6644 0.4958 H 1 UNL1 0.1838 51 H -8.6098 -0.8663 1.4728 H 1 UNL1 0.1312 52 H -8.8646 -1.3936 -0.2449 H 1 UNL1 0.1337 53 H -10.4800 0.7991 1.2596 H 1 UNL1 0.1549 54 H -10.6659 0.4465 -0.4561 H 1 UNL1 0.1783 55 H -11.3100 -1.9528 0.0642 H 1 UNL1 0.1441 56 H -11.1351 -1.6239 1.8141 H 1 UNL1 0.1108 57 H -13.6629 -2.1881 1.9878 H 1 UNL1 0.1159 58 H -14.7721 -1.1996 0.9920 H 1 UNL1 0.1474 59 H -13.7209 -2.3986 0.2134 H 1 UNL1 0.1483 @BOND 1 48 10 1 2 47 10 1 3 10 46 1 4 10 23 1 5 44 6 1 6 35 16 1 7 34 28 1 8 45 6 1 9 16 3 ar 10 16 15 ar 11 6 15 1 12 6 5 1 13 49 3 1 14 29 37 1 15 29 1 1 16 3 18 ar 17 37 27 2 18 15 17 ar 19 41 30 1 20 28 30 2 21 28 26 1 22 54 8 1 23 23 26 1 24 13 31 1 25 52 7 1 26 30 1 1 27 18 24 1 28 18 4 ar 29 17 4 ar 30 17 36 1 31 26 25 2 32 24 7 1 33 55 9 1 34 4 50 1 35 59 11 1 36 31 5 1 37 31 22 am 38 27 22 1 39 27 20 1 40 1 20 1 41 1 2 1 42 5 42 1 43 5 43 1 44 7 8 1 45 7 51 1 46 8 9 1 47 8 53 1 48 22 19 2 49 25 2 1 50 25 33 1 51 32 9 1 52 32 11 1 53 32 14 1 54 9 56 1 55 58 11 1 56 11 57 1 57 20 39 1 58 20 40 1 59 2 38 1 60 2 21 1 61 21 12 1